Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "eb1c7f14ee88c9c3decdab0a91ff0ca5",
"space_group_name": "F 4 3 2",
"unit_cell": {
"a": 177.14,
"b": 177.14,
"c": 177.14,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.330,1.690],
"number_observations": 2119682,
"number_observations_unique": 27095,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 42.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 78.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.690],
"number_observations": 146252,
"number_observations_unique": 1939,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.264
},
{
"type": "R(meas)",
"value": 4.292
},
{
"type": "R(pim)",
"value": 0.491
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 75.400
},
{
"type": "CC(1/2)",
"value": 0.779
}
]
},
{
"resolution_limits": [53.330,7.560],
"number_observations": 24247,
"number_observations_unique": 388,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
"value": 0.003
},
{
"type": "I/SigI",
"value": 167.600
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 62.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}